1-phenyl-3-[2-(2-phenylethynyl)phenyl]urea

Systemtic Name: 1-phenyl-3-[2-(2-phenylethynyl)phenyl]urea Openeye Name: 1-phenyl-3-[2-(2-phenylethynyl)phenyl]urea CAS Name: 1-phenyl-3-[2-(2-phenylethynyl)phenyl]urea IUPAC Name: 1-phenyl-3-[2-(2-phenylethynyl)phenyl]urea Traditional Name: 1-phenyl-3-[2-(2-phenylethynyl)phenyl]urea Formula: C21H16N2O MolecularWeight: 312.36454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=CC=C2NC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=CC=C2NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H16N2O/c24-21(22-19-12-5-2-6-13-19)23-20-14-8-7-11-18(20)16-15-17-9-3-1-4-10-17/h1-14H,(H2,22,23,24)